SCHEMBL17425522

SCHEMBL17425522

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5oc5c(-c7ccc(-c8ccccc8)cc7)cccc56)cc4)n3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.45
MAPT P10636 4/20 0.45
KDM4E B2RXH2 4/20 0.45
TSHR P16473 3/20 0.45
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ATM Q13315 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TP53 P04637 2/20 0.45
NFKB1 P19838 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MAPK1 P28482 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PRKDC P78527 4/20 0.44
PIK3CB P42338 4/20 0.44
PIK3CG P48736 4/20 0.44
PIK3CD O00329 3/20 0.44
PIK3CA P42336 3/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17425669 1.00 ALDH1A1 (0.45) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL17425492 1.00 ALDH1A1 (0.45) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL17425706 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL17425793 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL25645846 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL24217269 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL17425705 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL24525894 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL24216935 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD
SCHEMBL17425653 0.98 ALDH1A1 (0.44) ALDH1A1MAPTKDM4ETSHRHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11515484-B2 Heterocyclic compound and organic light emitting element comprising same LT MATERIALS CO., LTD. (KR) 2022-11-29 US disclosed
US-20200266355-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME HEESUNG MATERIAL LTD. (KR) 2020-08-20 US disclosed
EP-3683217-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LT Materials Co., Ltd. (KR) 2020-07-22 EP disclosed
US-20170054087-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-02-23 US disclosed
US-20160093808-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-03-31 US disclosed
US-20160028021-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-01-28 US disclosed
EP-2966706-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2016-01-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11515484-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, CYP1A1 ALDH1A1 15/4885MAPT 1487/4885KDM4E 2341/4885
US-20160028021-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OR10J3 ALDH1A1 1130/4885MAPT 1163/4885KDM4E 3396/4885
US-20200266355-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, CYP1A1 ALDH1A1 15/4885MAPT 1487/4885KDM4E 2341/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.